Home Carboxys 7H-Pyrido[1,2,3-de]-1,4-benzoxazine-6-carboxylic acid, 9,10-difluoro-2,3-dihydro-3-methyl-7-oxo-, ethyl ester, (3s)-

7H-Pyrido[1,2,3-de]-1,4-benzoxazine-6-carboxylic acid, 9,10-difluoro-2,3-dihydro-3-methyl-7-oxo-, ethyl ester, (3s)-

CAS No.:
106939-34-8
Catalog Number:
AG007TQ0
Molecular Formula:
C15H13F2NO4
Molecular Weight:
309.2648
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
5mg
98%powder
In Stock USA
United States
$87
- +
25mg
98%powder
In Stock USA
United States
$155
- +
1g
95%
In Stock USA
United States
$420
- +
5g
95%
In Stock USA
United States
$1680
- +
Product Description
Catalog Number:
AG007TQ0
Chemical Name:
7H-Pyrido[1,2,3-de]-1,4-benzoxazine-6-carboxylic acid, 9,10-difluoro-2,3-dihydro-3-methyl-7-oxo-, ethyl ester, (3s)-
CAS Number:
106939-34-8
Molecular Formula:
C15H13F2NO4
Molecular Weight:
309.2648
MDL Number:
MFCD09030626
IUPAC Name:
ethyl (2S)-6,7-difluoro-2-methyl-10-oxo-4-oxa-1-azatricyclo[7.3.1.05,13]trideca-5(13),6,8,11-tetraene-11-carboxylate
InChI:
InChI=1S/C15H13F2NO4/c1-3-21-15(20)9-5-18-7(2)6-22-14-11(17)10(16)4-8(12(14)18)13(9)19/h4-5,7H,3,6H2,1-2H3/t7-/m0/s1
InChI Key:
TZSXJUSNOOBBOP-ZETCQYMHSA-N
SMILES:
CCOC(=O)c1cn2[C@@H](C)COc3c2c(c1=O)cc(c3F)F
EC Number:
691-244-2
Properties
Complexity:
524  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
1  
Defined Bond Stereocenter Count:
0
Exact Mass:
309.081g/mol
Formal Charge:
0
Heavy Atom Count:
22  
Hydrogen Bond Acceptor Count:
7  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
309.269g/mol
Monoisotopic Mass:
309.081g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
55.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2  
Properties